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· · COA & SDS disponible pour chaque produit · Expédition le jour même sur les articles en stock Hexanedinitrile - ≥99% , CAS No.111-69-3
Synonyms
Tox21_300026 | A0168 | Adiponitrile, 99% | Nitrile adipico [Italian] | ADIPONITRILE | Adipyldinitrile | Hexanedinitrile | InChI=1/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H | AI3-11080 | MLS002415709 | Adipinsaeuredinitril | HSDB 627 | NCGC00090882-01 | UNII-SYT33B891
Storage
Room temperature,Argon charged,Desiccated
Shipped In
FedEx DG Service
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Why this grade ≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged,Desiccated Ships FedEx DG Service Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 12 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonymes
Tox21_300026 | A0168 | Adiponitrile, 99% | Nitrile adipico [Italian] | ADIPONITRILE | Adipyldinitrile | Hexanedinitrile | InChI=1/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H | AI3-11080 | MLS002415709 | Adipinsaeuredinitril | HSDB 627 | NCGC00090882-01 | UNII-SYT33B891
Spécifications et pureté
≥99%
Conditions de stockage de stockage
Room temperature,Argon charged,Desiccated
Expédié en
FedEx DG Service
Noms et identifiants Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488180701
Sourires canoniques
C(CCC#N)CC#N
IUPAC Name
hexanedinitrile
InChIKey
BTGRAWJCKBQKAO-UHFFFAOYSA-N
INCHI
1S/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H2
Isomères SMILES
C(CCC#N)CC#N
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740005&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organic nitrogen compounds Classe Organonitrogen compounds Subclass Organic cyanides Intermediate Tree Nodes Not available Direct Parent Nitriles Alternative Parents Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Structure 3D Cibles associées (humaines) Mécanismes d'action Certificats (CoA, COO, BSE/TSE et tableau d'analyse) Propriétés chimiques et physiques Solubilité Slightly soluble in water, ether and alcohol. Sensibilité Hygroscopic Indice de réfraction 1.437-1.439 Point d'éclair (°F) 325.4 °F Point d'éclair (°C) 163℃ Point d'ébullition (°C) 295°C Point de fusion (°C) 1-3°C Poids moléculaire 108.140 g/mol XLogP3 -0.300 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 3 Exact Mass 108.069 Da Monoisotopic Mass 108.069 Da Topological Polar Surface Area 47.600 Ų Heavy Atom Count 8 Formal Charge 0 Complexity 113.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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